5-Hydroxy-3-methyl-1-(6-nitro-2-benzothiazolyl)-1H-pyrazole-4-acetic a cid

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Names

[ CAS No. ]:
84968-81-0

[ Name ]:
5-Hydroxy-3-methyl-1-(6-nitro-2-benzothiazolyl)-1H-pyrazole-4-acetic a cid

Chemical & Physical Properties

[ Density]:
1.617g/cm3

[ Boiling Point ]:
639ºC at 760 mmHg

[ Molecular Formula ]:
C13H10N4O5S

[ Molecular Weight ]:
334.30700

[ Flash Point ]:
340.3ºC

[ Exact Mass ]:
334.03700

[ PSA ]:
162.04000

[ LogP ]:
2.14220

[ Index of Refraction ]:
1.717

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UQ4922500
CHEMICAL NAME :
1H-Pyrazole-4-acetic acid, 5-hydroxy-3-methyl-1-(6-nitro-2-benzothiazolyl)-
CAS REGISTRY NUMBER :
84968-81-0
LAST UPDATED :
198906
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H10-N4-O5-S
MOLECULAR WEIGHT :
334.33

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
700 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 21,869,1982

Related Compounds

  • 2-(4-(3-(Trifluoromethyl)phenyl)pyrimidin-5-yl)acetic acid
  • 4-Bromo-3-(difluoromethyl)-5-(trifluoromethyl)picolinic acid
  • (4-Amino-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-yl)methanol
  • 4-Bromo-5-(difluoromethyl)-6-fluoropyridine-3-sulfonamide
  • 4-(Difluoromethyl)-3-methoxy-2-methyl-5-nitropyridine
  • 4-Amino-5-(difluoromethyl)-6-methoxypicolinic acid
  • 4-(Difluoromethyl)-3-hydroxy-5-methylpicolinaldehyde
  • 4-Bromo-3-(difluoromethyl)-5-(fluoromethyl)pyridine
  • 4-(Difluoromethyl)-3-methoxy-6-methylpyridine-2-sulfonyl chloride
  • 4-Bromo-3-(difluoromethyl)-6-methoxypicolinic acid
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